Information card for entry 2231770

Structure parameters

• Chemical name: <i>trans</i>-Dibromidobis(1-ethyl-3-methylimidazol-2-ylidene)palladium(II)
• Formula: C12 H20 Br2 N4 Pd
• Calculated formula: C12 H20 Br2 N4 Pd
• SMILES: C1(N(C=CN1CC)C)=[Pd](=C1N(C=CN1C)CC)(Br)Br
• Title of publication: <i>trans</i>-Dibromidobis(1-ethyl-3-methylimidazol-2-ylidene)palladium(II)
• Authors of publication: Madsen, Solveig R.; Lock, Nina; Overgaard, Jacob; Iversen, Bo B.
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2011
• Journal volume: 67
• Journal issue: 9
• Pages of publication: m1205
• a: 8.3093 ± 0.0002 Å
• b: 8.6868 ± 0.0002 Å
• c: 12.0788 ± 0.0003 Å
• α: 90°
• β: 101.741 ± 0.001°
• γ: 90°
• Cell volume: 853.62 ± 0.04 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0615
• Residual factor for significantly intense reflections: 0.0439
• Weighted residual factors for all reflections included in the refinement: 0.1674
• Goodness-of-fit parameter for all reflections included in the refinement: 1.634
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes